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CAS 10599-69-6 2-Methyl-5-propionylfuran molecular structure lightbox
CAS RN: 10599-69-6

2-Methyl-5-propionylfuran

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250722 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: SSC-007622
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 100g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 10599-69-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Shenzhen Inquiry

10599-69-6 / 1-(5-methylfuran-2-yl)propan-1-one

2-Methyl-5-propionylfuran | 1-(5-methylfuran-2-yl)propan-1-one | 5-Methyl-2-propionylfuran

Standard CAS: 10599-69-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
10599-69-6
Multi CAS
Yes
Molecular Formula
C8H10O2
Molecular Weight
138.160000
Exact Mass
138.068080
SMILES
CCC(=O)C1=CC=C(O1)C
InChI
InChI=1S/C8H10O2/c1-3-7(9)8-5-4-6(2)10-8/h4-5H,3H2,1-2H3
InChIKey
BXLPZYAVKVFXEO-UHFFFAOYSA-N
Synonyms
2-Methyl-5-propionylfuran 1-(5-methylfuran-2-yl)propan-1-one 5-Methyl-2-propionylfuran 2-METHYL-5-PROPIONYL-FURAN 1-(5-Methyl-2-furyl)propan-1-one

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.38
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
38.07
TPSA
30.21

LogP / Solubility

WLOGP
2.18
MLOGP
1.91
XLogP3
1.9
Consensus LogP
2
Log S (ESOL)
-2.31
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.27
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.61
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.01

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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